CHEBI:177597 - Fispemifene

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Fispemifene
ChEBI ID CHEBI:177597
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H27ClO3
Net Charge 0
Average Mass 422.950
Monoisotopic Mass 422.16487
InChI InChI=1S/C26H27ClO3/c27-16-15-25(21-7-3-1-4-8-21)26(22-9-5-2-6-10-22)23-11-13-24(14-12-23)30-20-19-29-18-17-28/h1-14,28H,15-20H2/b26-25-
InChIKey NKZTZAQIKKGTDB-QPLCGJKRSA-N
SMILES ClCC/C(=C(/C1=CC=C(OCCOCCO)C=C1)\C2=CC=CC=C2)/C3=CC=CC=C3
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing Fispemifene (CHEBI:177597) is a stilbenoid (CHEBI:26776)
IUPAC Name
2-[2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]ethoxy]ethanol
Manual Xrefs Databases
8129643 ChemSpider
D10008 KEGG DRUG
DB06640 KEGG DRUG
View more database links
Registry Number Type Source
341524-89-8 CAS Registry Number ChemIDplus